2-[(4-bromophenyl)methylsulfanyl]-N'-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]ethanehydrazide

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-N'-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]ethanehydrazide Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-N'-[(E)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]acetohydrazide CAS Name: 2-[(4-bromophenyl)methylthio]-N'-[(E)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]acetohydrazide IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-N'-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]acetohydrazide Traditional Name: 2-[(4-bromobenzyl)thio]-N'-[(E)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]acetohydrazide Formula: C20H19BrN4O2S MolecularWeight: 459.35946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNNC(=O)CSCC2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/NNC(=O)CSCC2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C20H19BrN4O2S/c1-14-18(20(27)25(24-14)17-5-3-2-4-6-17)11-22-23-19(26)13-28-12-15-7-9-16(21)10-8-15/h2-11,22H,12-13H2,1H3,(H,23,26)/b18-11+